3-(2,5-dimethoxyphenyl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: 3-(2,5-dimethoxyphenyl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide Openeye Name: 3-(2,5-dimethoxyphenyl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide CAS Name: 3-(2,5-dimethoxyphenyl)-N-[(1,3-diphenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: 3-(2,5-dimethoxyphenyl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propanamide Traditional Name: 3-(2,5-dimethoxyphenyl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]propionamide Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCC(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCC(=O)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O3/c1-32-24-14-15-25(33-2)21(17-24)13-16-26(31)28-18-22-19-30(23-11-7-4-8-12-23)29-27(22)20-9-5-3-6-10-20/h3-12,14-15,17,19H,13,16,18H2,1-2H3,(H,28,31)